ethyl 2-[[2-ethyl-5-(5-fluoranyl-2-methoxy-phenyl)-3,4-dihydro-1H-isoquinolin-8-yl]carbamoylamino]ethanoate

Systemtic Name: ethyl 2-[[2-ethyl-5-(5-fluoranyl-2-methoxy-phenyl)-3,4-dihydro-1H-isoquinolin-8-yl]carbamoylamino]ethanoate Openeye Name: ethyl 2-[[2-ethyl-5-(5-fluoro-2-methoxy-phenyl)-3,4-dihydro-1H-isoquinolin-8-yl]carbamoylamino]acetate CAS Name: 2-[[[[2-ethyl-5-(5-fluoro-2-methoxyphenyl)-3,4-dihydro-1H-isoquinolin-8-yl]amino]-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-ethyl-5-(5-fluoro-2-methoxyphenyl)-3,4-dihydro-1H-isoquinolin-8-yl]carbamoylamino]acetate Traditional Name: 2-[[2-ethyl-5-(5-fluoro-2-methoxy-phenyl)-3,4-dihydro-1H-isoquinolin-8-yl]carbamoylamino]acetic acid ethyl ester Formula: C23H28FN3O4 MolecularWeight: 429.484523

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=C(C=CC(=C2C1)NC(=O)NCC(=O)OCC)C3=C(C=CC(=C3)F)OC

Isomeric SMILES

CCN1CCC2=C(C=CC(=C2C1)NC(=O)NCC(=O)OCC)C3=C(C=CC(=C3)F)OC

InChI

InChI=1S/C23H28FN3O4/c1-4-27-11-10-17-16(18-12-15(24)6-9-21(18)30-3)7-8-20(19(17)14-27)26-23(29)25-13-22(28)31-5-2/h6-9,12H,4-5,10-11,13-14H2,1-3H3,(H2,25,26,29)